5-(4-pentylphenyl)-4-[2-(4-pentylphenyl)ethynyl]thieno[2,3-c]pyran-7-one

Systemtic Name: 5-(4-pentylphenyl)-4-[2-(4-pentylphenyl)ethynyl]thieno[2,3-c]pyran-7-one Openeye Name: 5-(4-pentylphenyl)-4-[2-(4-pentylphenyl)ethynyl]thieno[2,3-c]pyran-7-one CAS Name: 5-(4-pentylphenyl)-4-[2-(4-pentylphenyl)ethynyl]-7-thieno[2,3-c]pyranone IUPAC Name: 5-(4-pentylphenyl)-4-[2-(4-pentylphenyl)ethynyl]thieno[2,3-c]pyran-7-one Traditional Name: 5-(4-amylphenyl)-4-[2-(4-amylphenyl)ethynyl]thieno[2,3-c]pyran-7-one Formula: C31H32O2S MolecularWeight: 468.64958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=C(OC(=O)C3=C2C=CS3)C4=CC=C(C=C4)CCCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=C(OC(=O)C3=C2C=CS3)C4=CC=C(C=C4)CCCCC

InChI

InChI=1S/C31H32O2S/c1-3-5-7-9-23-11-13-25(14-12-23)17-20-27-28-21-22-34-30(28)31(32)33-29(27)26-18-15-24(16-19-26)10-8-6-4-2/h11-16,18-19,21-22H,3-10H2,1-2H3